(3R)-3-(2-ethoxyanilino)-1-(3-methoxyphenyl)pyrrolidine-2,5-dione

C19H20N2O4 — CID 51860106

IUPAC(3R)-3-(2-ethoxyanilino)-1-(3-methoxyphenyl)pyrrolidine-2,5-dione
SMILESCCOc1ccccc1N[C@@H]1CC(=O)N(c2cccc(OC)c2)C1=O
InChIInChI=1S/C19H20N2O4/c1-3-25-17-10-5-4-9-15(17)20-16-12-18(22)21(19(16)23)13-7-6-8-14(11-13)24-2/h4-11,16,20H,3,12H2,1-2H3/t16-/m1/s1
InChIKeyDBIAIYFPUNCKRS-MRXNPFEDSA-N
MW340.38 g/mol
LogP2.84
Rot. Bonds6

About (3R)-3-(2-ethoxyanilino)-1-(3-methoxyphenyl)pyrrolidine-2,5-dione

(3R)-3-(2-ethoxyanilino)-1-(3-methoxyphenyl)pyrrolidine-2,5-dione (PubChem CID 51860106) has the molecular formula C19H20N2O4 and a molecular weight of 340.38 g/mol. Its IUPAC name is (3R)-3-(2-ethoxyanilino)-1-(3-methoxyphenyl)pyrrolidine-2,5-dione.

Molecular Properties

Compound Name(3R)-3-(2-ethoxyanilino)-1-(3-methoxyphenyl)pyrrolidine-2,5-dione
PubChem CID51860106
Molecular FormulaC19H20N2O4
Molecular Weight340.38 g/mol
Exact Mass340.14
IUPAC Name(3R)-3-(2-ethoxyanilino)-1-(3-methoxyphenyl)pyrrolidine-2,5-dione
SMILESCCOc1ccccc1N[C@@H]1CC(=O)N(c2cccc(OC)c2)C1=O
InChIInChI=1S/C19H20N2O4/c1-3-25-17-10-5-4-9-15(17)20-16-12-18(22)21(19(16)23)13-7-6-8-14(11-13)24-2/h4-11,16,20H,3,12H2,1-2H3/t16-/m1/s1
InChIKeyDBIAIYFPUNCKRS-MRXNPFEDSA-N
XLogP2.84
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.38
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Related Compounds

(3R)-3-(2-chloroanilino)-1-(3-methoxyphenyl)pyrrolidine-2,5-dione
CID 98188137
(3S)-3-(2-ethoxyanilino)-1-(4-ethylphenyl)pyrrolidine-2,5-dione
CID 51860069
(3R)-1-(4-chlorophenyl)-3-(2-ethoxyanilino)pyrrolidine-2,5-dione
CID 51860298
3-(2-ethoxyanilino)-1-(2-ethylphenyl)pyrrolidine-2,5-dione
CID 43844529
(3S)-3-(2-methoxyanilino)-1-(4-methoxyphenyl)pyrrolidine-2,5-dione
CID 51860123
(3R)-3-(2-ethoxyanilino)-1-(2-methylphenyl)pyrrolidine-2,5-dione
CID 51859878
(3R)-3-(4-methoxyanilino)-1-(3-methoxyphenyl)pyrrolidine-2,5-dione
CID 691645
3-(2-ethoxyanilino)-1-ethylpyrrolidine-2,5-dione
CID 43411500
3-(3,5-dimethylanilino)-1-(3-methoxyphenyl)pyrrolidine-2,5-dione
CID 78665094
3-[(3S)-3-(2,4-dimethoxyanilino)-2,5-dioxopyrrolidin-1-yl]benzoic acid
CID 93235150
(3S)-1-(4-fluorophenyl)-3-(2-methoxyanilino)pyrrolidine-2,5-dione
CID 93235253
1-(4-ethylphenyl)-3-(3-methoxyanilino)pyrrolidine-2,5-dione
CID 43844549

Frequently Asked Questions

What is the IUPAC name of (3R)-3-(2-ethoxyanilino)-1-(3-methoxyphenyl)pyrrolidine-2,5-dione?
The IUPAC name of (3R)-3-(2-ethoxyanilino)-1-(3-methoxyphenyl)pyrrolidine-2,5-dione (CID 51860106) is (3R)-3-(2-ethoxyanilino)-1-(3-methoxyphenyl)pyrrolidine-2,5-dione.
What is the SMILES notation for (3R)-3-(2-ethoxyanilino)-1-(3-methoxyphenyl)pyrrolidine-2,5-dione?
The canonical SMILES for (3R)-3-(2-ethoxyanilino)-1-(3-methoxyphenyl)pyrrolidine-2,5-dione is CCOc1ccccc1N[C@@H]1CC(=O)N(c2cccc(OC)c2)C1=O.
What is the InChIKey of (3R)-3-(2-ethoxyanilino)-1-(3-methoxyphenyl)pyrrolidine-2,5-dione?
The InChIKey is DBIAIYFPUNCKRS-MRXNPFEDSA-N. The full InChI is InChI=1S/C19H20N2O4/c1-3-25-17-10-5-4-9-15(17)20-16-12-18(22)21(19(16)23)13-7-6-8-14(11-13)24-2/h4-11,16,20H,3,12H2,1-2H3/t16-/m1/s1.
What are the key properties of (3R)-3-(2-ethoxyanilino)-1-(3-methoxyphenyl)pyrrolidine-2,5-dione?
(3R)-3-(2-ethoxyanilino)-1-(3-methoxyphenyl)pyrrolidine-2,5-dione has a molecular weight of 340.38 g/mol, XLogP of 2.84, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-(2-ethoxyanilino)-1-(3-methoxyphenyl)pyrrolidine-2,5-dione is sourced from PubChem (CID 51860106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).